N-(2-methoxy-5-nitro-phenyl)-4-methyl-N-[(2R)-3-morpholin-4-yl-2-oxidanyl-propyl]benzenesulfonamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-4-methyl-N-[(2R)-3-morpholin-4-yl-2-oxidanyl-propyl]benzenesulfonamide Openeye Name: N-[(2R)-2-hydroxy-3-morpholino-propyl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide CAS Name: N-[(2R)-2-hydroxy-3-(4-morpholinyl)propyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzenesulfonamide IUPAC Name: N-[(2R)-2-hydroxy-3-morpholin-4-ylpropyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzenesulfonamide Traditional Name: N-[(2R)-2-hydroxy-3-morpholino-propyl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide Formula: C21H27N3O7S MolecularWeight: 465.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2CCOCC2)O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C[C@@H](CN2CCOCC2)O)C3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H27N3O7S/c1-16-3-6-19(7-4-16)32(28,29)23(15-18(25)14-22-9-11-31-12-10-22)20-13-17(24(26)27)5-8-21(20)30-2/h3-8,13,18,25H,9-12,14-15H2,1-2H3/t18-/m1/s1